1-[(4-bromanylpyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-bromanylpyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-[(4-bromo-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-bromopyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]pyrazole-3-carboxamide Formula: C20H23BrN6O MolecularWeight: 443.34022

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=NN(C=C3)CN4C=C(C=N4)Br

InChI

InChI=1S/C20H23BrN6O/c21-17-12-22-27(14-17)15-26-11-8-19(24-26)20(28)23-18-6-4-16(5-7-18)13-25-9-2-1-3-10-25/h4-8,11-12,14H,1-3,9-10,13,15H2,(H,23,28)